SCHEMBL31388739

SCHEMBL31388739

CC(C)(NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.36
▸ ACE P12821 2/20 0.34
▸ MME P08473 1/20 0.33
▸ ACE2 Q9BYF1 1/20 0.33
▸ GLP1R P43220 1/20 0.31
▸ SCTR P47872 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ CPB2 Q96IY4 2/20 0.30
▸ CPB1 P15086 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29837202 0.91 GLP1R (0.36) GRB2GLP1RSCTR
SCHEMBL31388786 0.90 GRB2 (0.37) GRB2MMEGLP1RSCTR
SCHEMBL29545820 0.85 CTSC (0.33) —
SCHEMBL9665035 0.84 MME (0.35) MME
SCHEMBL2958250 0.84 MME (0.35) MME
SCHEMBL23598223 0.84 MME (0.35) MME
SCHEMBL2962003 0.84 MME (0.35) MME
SCHEMBL2958246 0.84 MME (0.35) MME
SCHEMBL9665040 0.84 MME (0.35) MME
Hydrochloric Acid SCHEMBL6933795 0.83 MME (0.34) MME

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4745153-A1 GLP-1, GIP AND GCG RECEPTOR TRIAGONIST AND USE THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2026-05-20 — — EP disclosed
WO-2025016303-A1 GLP-1, GIP AND GCG RECEPTOR TRIAGONIST AND USE THEREOF 北京拓界生物医药科技有限公司 2025-01-23 — — WO disclosed
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